[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate

Systemtic Name: [2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Openeye Name: [2-(4-cyclohexylphenyl)-2-oxo-ethyl] 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate CAS Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid [2-(4-cyclohexylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-cyclohexylphenyl)-2-oxoethyl] 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoate Traditional Name: 3-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzoic acid [2-(4-cyclohexylphenyl)-2-keto-ethyl] ester Formula: C30H31NO5S MolecularWeight: 517.63584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC5=CC=CC=C54

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)COC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C30H31NO5S/c32-29(25-17-15-23(16-18-25)22-8-2-1-3-9-22)21-36-30(33)26-11-6-13-27(20-26)37(34,35)31-19-7-12-24-10-4-5-14-28(24)31/h4-6,10-11,13-18,20,22H,1-3,7-9,12,19,21H2